N-[2-[(2,5-dimethylphenyl)amino]-2-oxidanylidene-ethyl]-4-(1,3-dithian-2-yl)-N-methyl-benzamide

Systemtic Name: N-[2-[(2,5-dimethylphenyl)amino]-2-oxidanylidene-ethyl]-4-(1,3-dithian-2-yl)-N-methyl-benzamide Openeye Name: N-[2-(2,5-dimethylanilino)-2-oxo-ethyl]-4-(1,3-dithian-2-yl)-N-methyl-benzamide CAS Name: N-[2-(2,5-dimethylanilino)-2-oxoethyl]-4-(1,3-dithian-2-yl)-N-methylbenzamide IUPAC Name: N-[2-(2,5-dimethylanilino)-2-oxoethyl]-4-(1,3-dithian-2-yl)-N-methylbenzamide Traditional Name: N-[2-(2,5-dimethylanilino)-2-keto-ethyl]-4-(1,3-dithian-2-yl)-N-methyl-benzamide Formula: C22H26N2O2S2 MolecularWeight: 414.58404

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)NC(=O)CN(C)C(=O)C2=CC=C(C=C2)C3SCCCS3

Isomeric SMILES

CC1=CC(=C(C=C1)C)NC(=O)CN(C)C(=O)C2=CC=C(C=C2)C3SCCCS3

InChI

InChI=1S/C22H26N2O2S2/c1-15-5-6-16(2)19(13-15)23-20(25)14-24(3)21(26)17-7-9-18(10-8-17)22-27-11-4-12-28-22/h5-10,13,22H,4,11-12,14H2,1-3H3,(H,23,25)